5-Methoxy-2-methyl-1-benzofuran-3-carboxylic acid
TL;DR: 5-Methoxy-2-methyl-1-benzofuran-3-carboxylic acid (CAS 29735-88-4) is a chemical compound with molecular formula C11H10O4 and molecular weight 206.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methoxy-2-methyl-1-benzofuran-3-carboxylic acid
Also Known As: 5-methoxy-2-methyl-1-benzofuran-3-carboxylic acid, 5-Methoxy-2-methyl-benzofuran-3-carboxylic acid, t-Butyltrifluoroacetate, 3-Benzofurancarboxylic acid, 5-methoxy-2-methyl-, 5-methoxy-2-methylbenzofuran-3-carboxylic acid
| Molecular Formula | C11H10O4 |
|---|---|
| Molecular Weight | 206.06 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 59.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 206.0579 |
| Heavy Atoms | 15 |
| Complexity | 253.0 |
Chemical Identifiers
| CAS Number | 29735-88-4 |
|---|---|
| SMILES | CC1=C(C2=C(O1)C=CC(=C2)OC)C(=O)O |
| InChIKey | RSHSSGDUMLTSEG-UHFFFAOYSA-N |
Product Overview
5-Methoxy-2-methyl-1-benzofuran-3-carboxylic acid (CAS 29735-88-4), with molecular formula C11H10O4 and molecular weight 206.06 g/mol. IUPAC: 5-methoxy-2-methyl-1-benzofuran-3-carboxylic acid.
Chemical Property Profile of 5-Methoxy-2-methyl-1-benzofuran-3-carboxylic acid
Property Insights of 5-Methoxy-2-methyl-1-benzofuran-3-carboxylic acid
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Methoxy-2-methyl-1-benzofuran-3-carboxylic acid. With a topological polar surface area (TPSA) of 59.7 Ų, 5-Methoxy-2-methyl-1-benzofuran-3-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Methoxy-2-methyl-1-benzofuran-3-carboxylic acid has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-Methoxy-2-methyl-1-benzofuran-3-carboxylic acid?
The CAS number of 5-Methoxy-2-methyl-1-benzofuran-3-carboxylic acid is 29735-88-4.
What is the molecular formula of 5-Methoxy-2-methyl-1-benzofuran-3-carboxylic acid?
The molecular formula of 5-Methoxy-2-methyl-1-benzofuran-3-carboxylic acid is C11H10O4.
What is the molecular weight of 5-Methoxy-2-methyl-1-benzofuran-3-carboxylic acid?
The molecular weight of 5-Methoxy-2-methyl-1-benzofuran-3-carboxylic acid is 206.06 g/mol.
Where can I buy 5-Methoxy-2-methyl-1-benzofuran-3-carboxylic acid?
You can request a quote for 5-Methoxy-2-methyl-1-benzofuran-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methoxy-2-methyl-1-benzofuran-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Methoxy-2-methyl-1-benzofuran-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.